#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9h s SER 2 N 0.00 4.51 0.07 1.61 1.04 -1.26 -5.15 113.70 114.52 2d9h s SER 2 Ca 0.00 -0.75 -0.07 0.00 0.48 0.00 0.00 55.95 55.60 2d9h s SER 2 Cb 0.00 -0.75 -0.01 0.00 0.10 0.00 0.00 66.02 65.37 2d9h s SER 2 CO 0.00 -0.13 0.15 -0.44 0.98 0.00 0.00 173.24 173.80 2d9h s SER 3 N -3.73 0.16 0.00 7.02 0.01 -1.26 -5.17 113.70 110.74 2d9h s SER 3 Ca 0.34 -0.64 0.00 0.00 1.31 0.00 0.00 55.95 56.96 2d9h s SER 3 Cb -0.04 0.30 0.00 0.00 0.21 0.00 0.00 66.02 66.49 2d9h s SER 3 CO 0.21 -0.66 0.00 0.61 0.41 0.00 0.00 173.24 173.80 2d9h n GLY 4 N 0.16 2.90 3.72 3.44 0.00 -1.26 -5.13 105.19 109.02 2d9h n GLY 4 Ca -0.16 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 2d9h n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d9h s SER 5 N 0.00 6.54 0.01 1.61 0.01 -1.26 -4.92 113.70 115.69 2d9h s SER 5 Ca 0.00 2.68 -0.23 0.00 1.31 0.00 0.00 55.95 59.71 2d9h s SER 5 Cb 0.00 -2.60 -0.17 0.00 0.21 0.00 0.00 66.02 63.46 2d9h s SER 5 CO 0.00 -0.85 1.30 0.28 0.41 0.00 0.00 173.24 174.38 2d9h h SER 6 N 6.73 0.20 -5.00 2.44 0.02 -2.00 -3.50 113.55 112.44 2d9h h SER 6 Ca -0.43 -0.49 0.00 0.00 -0.84 0.00 0.00 61.79 60.03 2d9h h SER 6 Cb 1.20 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.69 2d9h h SER 6 CO 0.92 0.65 0.00 0.61 -1.14 0.00 0.00 176.83 177.87 2d9h n GLY 7 N 0.23 2.96 3.82 -3.77 0.00 -1.26 -5.02 105.19 102.16 2d9h n GLY 7 Ca -0.07 -1.88 -0.31 0.00 0.00 0.00 0.00 46.02 43.76 2d9h n GLY 7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2d9h s LEU 8 N 0.00 3.08 -0.08 0.99 1.43 0.16 -4.87 118.68 119.39 2d9h s LEU 8 Ca 0.00 1.56 -0.02 0.00 -1.03 0.00 0.00 54.13 54.64 2d9h s LEU 8 Cb 0.00 -4.42 0.03 0.00 0.03 0.00 0.00 46.19 41.83 2d9h s LEU 8 CO 0.00 -1.45 0.02 -1.58 0.23 0.00 0.00 176.35 173.57 2d9h s GLN 9 N -5.07 0.40 0.48 1.70 2.00 -1.26 -2.40 119.66 115.50 2d9h s GLN 9 Ca 0.58 0.13 -0.21 0.00 -2.00 0.00 0.00 55.36 53.86 2d9h s GLN 9 Cb -0.14 -0.99 -0.08 0.00 0.80 0.00 0.00 33.01 32.61 2d9h s GLN 9 CO 0.55 -0.36 1.07 0.00 -0.50 0.00 0.00 175.29 176.05 2d9h n GLU 11 N -0.85 0.68 0.04 0.00 0.28 -1.26 -3.18 120.64 116.35 2d9h n GLU 11 Ca 0.09 0.04 -0.02 0.00 -0.16 0.00 0.00 57.16 57.10 2d9h n GLU 11 Cb 0.51 -1.56 -0.01 0.00 1.43 0.00 0.00 31.44 31.81 2d9h n GLU 11 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 2d9h h ILE 12 N 0.00 0.00 0.00 3.84 1.08 -1.99 -3.39 117.51 117.05 2d9h h ILE 12 Ca -0.50 0.00 -0.38 0.00 -0.39 0.00 0.00 64.86 63.59 2d9h h ILE 12 Cb 2.20 0.00 -0.07 0.00 -3.07 0.00 0.00 36.82 35.89 2d9h h ILE 12 CO 0.04 0.00 -2.42 0.00 -0.69 0.00 0.00 178.15 175.08 2d9h n GLY 14 N 2.21 2.00 3.88 0.00 0.00 -1.19 -5.07 105.19 107.01 2d9h n GLY 14 Ca -0.45 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.28 2d9h n GLY 14 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2d9h s PHE 15 N -2.00 1.95 -0.02 1.61 5.36 -1.26 -4.67 117.98 118.95 2d9h s PHE 15 Ca 0.00 0.51 0.01 0.00 -0.96 0.00 0.00 56.93 56.48 2d9h s PHE 15 Cb 0.00 -3.82 0.02 0.00 -0.34 0.00 0.00 43.02 38.88 2d9h s PHE 15 CO 0.00 -2.51 -0.01 0.95 -1.46 0.00 0.00 175.22 172.19 2d9h s THR 16 N -3.66 0.20 -0.02 0.12 -4.23 -1.26 -0.29 115.64 106.51 2d9h s THR 16 Ca 0.69 0.02 -0.10 0.00 -1.18 0.00 0.00 61.69 61.13 2d9h s THR 16 Cb -0.07 -0.26 0.01 0.00 1.34 0.00 0.00 72.50 73.51 2d9h s THR 16 CO 0.52 0.13 0.21 0.00 -0.54 0.00 0.00 174.62 174.93 2d9h h ARG 18 N 4.41 0.00 -6.95 0.00 -0.00 -1.94 0.47 114.38 110.37 2d9h h ARG 18 Ca -0.30 0.00 -0.50 0.00 -0.50 0.00 0.00 59.98 58.68 2d9h h ARG 18 Cb 1.19 0.00 0.04 0.00 0.00 0.00 0.00 29.97 31.20 2d9h h ARG 18 CO 0.40 0.20 0.48 -0.65 0.00 0.00 0.00 179.97 180.39 2d9h s GLN 19 N -1.85 4.06 -0.02 0.04 -1.52 -1.26 -4.61 119.66 114.50 2d9h s GLN 19 Ca -0.08 1.74 -0.20 0.00 -1.95 0.00 0.00 55.36 54.87 2d9h s GLN 19 Cb 0.00 -2.62 -0.13 0.00 -0.22 0.00 0.00 33.01 30.05 2d9h s GLN 19 CO 0.18 -0.29 0.89 0.87 -0.25 0.00 0.00 175.29 176.69 2d9h h LYS 20 N 2.55 -0.49 -0.78 2.91 1.79 -2.01 -3.19 116.57 117.35 2d9h h LYS 20 Ca -0.49 0.03 0.29 0.00 -2.18 0.00 0.00 60.65 58.30 2d9h h LYS 20 Cb 1.23 0.11 -0.14 0.00 -1.58 0.00 0.00 32.23 31.85 2d9h h LYS 20 CO 0.62 -0.20 0.27 0.00 -1.08 0.00 0.00 179.45 179.06 2d9h n ALA 21 N -2.64 0.65 0.31 3.86 0.00 -1.26 0.59 120.51 122.03 2d9h n ALA 21 Ca -0.08 0.81 -0.16 0.00 0.00 0.00 0.00 53.44 54.00 2d9h n ALA 21 Cb 0.26 -0.73 -0.08 0.00 0.00 0.00 0.00 19.45 18.90 2d9h n ALA 21 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2d9h h SER 22 N 0.00 -0.66 -0.70 0.00 0.02 -1.97 -1.87 113.55 108.37 2d9h h SER 22 Ca 0.59 -0.02 0.15 0.00 -0.84 0.00 0.00 61.79 61.67 2d9h h SER 22 Cb 1.46 0.17 -0.13 0.00 0.14 0.00 0.00 62.40 64.05 2d9h h SER 22 CO -0.65 -0.39 -0.09 0.25 -1.14 0.00 0.00 176.83 174.81 2d9h h LEU 23 N -0.91 -0.50 0.30 5.07 5.85 0.16 0.68 115.31 125.97 2d9h h LEU 23 Ca -0.08 0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 2d9h h LEU 23 Cb 0.64 0.38 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 2d9h h LEU 23 CO 0.13 -0.20 -0.23 0.78 -0.34 0.00 0.00 178.44 178.58 2d9h h ASN 24 N 0.05 -0.60 0.18 1.25 2.35 -1.29 0.12 115.58 117.64 2d9h h ASN 24 Ca 0.36 0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 56.14 2d9h h ASN 24 Cb 0.58 0.19 -0.00 0.00 0.05 0.00 0.00 38.32 39.15 2d9h h ASN 24 CO -0.67 -0.36 -0.08 -0.25 -1.65 0.00 0.00 177.43 174.42 2d9h h TRP 25 N -0.54 0.00 0.00 1.19 2.91 -0.36 -0.26 115.95 118.89 2d9h h TRP 25 Ca -0.02 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.00 2d9h h TRP 25 Cb 0.47 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.12 2d9h h TRP 25 CO -0.13 0.08 -0.24 1.25 -1.03 0.00 0.00 178.44 178.37 2d9h h HIS 26 N 0.00 0.00 0.03 2.65 2.76 0.11 -3.31 115.15 117.40 2d9h h HIS 26 Ca -0.00 0.00 -0.29 0.00 -2.20 0.00 0.00 60.37 57.88 2d9h h HIS 26 Cb 0.20 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.12 2d9h h HIS 26 CO 0.00 0.00 -1.60 1.04 -1.30 0.00 0.00 177.93 176.07 2d9h n GLN 27 N -2.35 0.62 -0.31 5.26 6.02 0.34 -4.21 117.38 122.75 2d9h n GLN 27 Ca 0.04 0.46 0.20 0.00 -0.01 0.00 0.00 57.00 57.69 2d9h n GLN 27 Cb 0.45 -1.71 0.47 0.00 1.02 0.00 0.00 30.24 30.47 2d9h n GLN 27 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.06 176.12 2d9h h ARG 28 N -0.70 0.46 -0.99 -1.09 0.11 -1.33 0.19 114.38 111.03 2d9h h ARG 28 Ca -0.41 -0.03 0.04 0.00 0.10 0.00 0.00 59.98 59.68 2d9h h ARG 28 Cb 1.54 -0.10 -0.06 0.00 1.11 0.00 0.00 29.97 32.46 2d9h h ARG 28 CO -0.15 0.30 0.65 1.57 0.10 0.00 0.00 179.97 182.44 2d9h h LYS 29 N 0.47 1.22 -0.67 0.08 2.10 -1.73 -2.34 116.57 115.69 2d9h h LYS 29 Ca 0.56 -0.07 0.13 0.00 -2.00 0.00 0.00 60.65 59.27 2d9h h LYS 29 Cb 1.30 -0.27 -0.09 0.00 -0.90 0.00 0.00 32.23 32.26 2d9h h LYS 29 CO -0.29 0.80 0.20 0.45 -2.00 0.00 0.00 179.45 178.61 2d9h h HIS 30 N 1.25 0.32 -1.25 0.07 3.86 -0.78 0.11 115.15 118.74 2d9h h HIS 30 Ca 0.39 0.04 0.36 0.00 -1.16 0.00 0.00 60.37 60.00 2d9h h HIS 30 Cb 0.00 -0.04 -0.05 0.00 1.06 0.00 0.00 27.41 28.38 2d9h h HIS 30 CO -0.00 -0.00 1.12 0.00 0.86 0.00 0.00 177.93 179.90 2d9h h ALA 31 N 1.52 3.14 0.05 2.45 0.00 -1.44 0.58 119.26 125.56 2d9h h ALA 31 Ca 0.36 -0.04 -0.37 0.00 0.00 0.00 0.00 54.91 54.86 2d9h h ALA 31 Cb 0.55 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 2d9h h ALA 31 CO -0.42 -1.76 -2.23 0.39 0.00 0.00 0.00 179.25 175.23 2d9h n GLU 32 N -3.65 0.70 -0.13 0.00 -0.58 0.33 -4.31 120.64 112.99 2d9h n GLU 32 Ca 0.28 0.20 -0.00 0.00 -0.42 0.00 0.00 57.16 57.21 2d9h n GLU 32 Cb 1.50 -1.61 0.26 0.00 -0.57 0.00 0.00 31.44 31.02 2d9h n GLU 32 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 2d9h h THR 33 N 0.03 1.19 -0.96 2.62 2.02 0.60 -2.87 112.91 115.54 2d9h h THR 33 Ca -0.50 -0.54 0.34 0.00 0.77 0.00 0.00 66.41 66.48 2d9h h THR 33 Cb 1.98 0.46 -0.10 0.00 -1.74 0.00 0.00 68.15 68.75 2d9h h THR 33 CO 0.00 0.22 0.61 1.33 0.37 0.00 0.00 175.52 178.06 2d9h n VAL 34 N -4.36 -0.19 -0.03 3.16 0.24 0.66 0.17 118.33 117.98 2d9h n VAL 34 Ca 0.05 1.30 -0.09 0.00 -2.04 0.00 0.00 64.34 63.56 2d9h n VAL 34 Cb 0.13 -2.13 -0.03 0.00 -1.47 0.00 0.00 33.84 30.34 2d9h n VAL 34 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2d9h h ALA 35 N 1.16 0.09 -1.00 2.33 0.00 -1.79 -1.98 119.26 118.07 2d9h h ALA 35 Ca 0.63 0.07 0.23 0.00 0.00 0.00 0.00 54.91 55.83 2d9h h ALA 35 Cb 1.99 0.16 -0.12 0.00 0.00 0.00 0.00 17.79 19.83 2d9h h ALA 35 CO -0.35 -0.50 0.59 0.00 0.00 0.00 0.00 179.25 178.99 2d9h h ALA 36 N 1.13 1.73 -2.04 0.00 0.00 0.15 -3.38 119.26 116.85 2d9h h ALA 36 Ca 0.09 0.11 -0.57 0.00 0.00 0.00 0.00 54.91 54.54 2d9h h ALA 36 Cb 0.16 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2d9h h ALA 36 CO -0.19 -0.20 1.17 -0.51 0.00 0.00 0.00 179.25 179.52 2d9h s LEU 37 N -10.34 3.87 -0.01 0.00 1.43 -0.74 -4.08 118.68 108.81 2d9h s LEU 37 Ca -0.11 1.69 0.02 0.00 -1.03 0.00 0.00 54.13 54.70 2d9h s LEU 37 Cb 0.26 -3.53 -0.03 0.00 0.03 0.00 0.00 46.19 42.92 2d9h s LEU 37 CO 0.80 -1.32 0.03 0.54 0.23 0.00 0.00 176.35 176.62 2d9h n ARG 38 N 7.78 1.98 -3.28 1.70 3.00 -0.04 -4.77 116.66 123.02 2d9h n ARG 38 Ca 0.20 -0.01 -0.45 0.00 -0.01 0.00 0.00 57.85 57.58 2d9h n ARG 38 Cb 0.45 -1.06 -0.06 0.00 0.00 0.00 0.00 32.46 31.80 2d9h n ARG 38 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 2d9h s PHE 39 N -2.10 3.19 1.03 -1.55 0.40 -0.83 -4.93 117.98 113.18 2d9h s PHE 39 Ca -0.01 -1.06 -0.13 0.00 -0.60 0.00 0.00 56.93 55.13 2d9h s PHE 39 Cb 0.01 -3.63 0.21 0.00 0.51 0.00 0.00 43.02 40.11 2d9h s PHE 39 CO 0.09 -1.00 1.09 -1.25 0.70 0.00 0.00 175.22 174.85 2d9h s PRO 40 N 1.89 0.17 -0.40 0.24 0.04 -1.26 -1.21 135.00 134.47 2d9h s PRO 40 Ca 0.06 0.43 -0.10 0.00 0.04 0.00 0.00 61.00 61.43 2d9h s PRO 40 Cb -0.26 -1.71 0.06 0.00 0.04 0.00 0.00 34.50 32.62 2d9h s PRO 40 CO 0.05 -2.89 0.24 0.00 0.04 0.00 0.00 177.00 174.45 2d9h n GLU 42 N 4.96 0.30 -0.11 0.00 -0.00 -1.26 0.11 120.64 124.64 2d9h n GLU 42 Ca -0.11 0.02 -0.20 0.00 -0.00 0.00 0.00 57.16 56.87 2d9h n GLU 42 Cb 0.44 -1.50 -0.09 0.00 -0.00 0.00 0.00 31.44 30.29 2d9h n GLU 42 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 2d9h n PHE 43 N -1.03 0.67 -0.01 -1.84 3.72 -1.26 -4.81 117.46 112.90 2d9h n PHE 43 Ca 0.07 0.29 -0.01 0.00 -0.05 0.00 0.00 57.45 57.75 2d9h n PHE 43 Cb 0.04 -0.98 -0.01 0.00 -0.94 0.00 0.00 39.48 37.59 2d9h n PHE 43 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2d9h n GLY 45 N 3.16 1.12 3.04 0.00 0.00 0.30 -5.00 105.19 107.82 2d9h n GLY 45 Ca -0.04 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.79 2d9h n GLY 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2d9h n LYS 46 N 0.00 -3.00 -3.79 1.61 5.02 -1.26 -3.93 118.16 112.82 2d9h n LYS 46 Ca 0.00 -0.89 -0.13 0.00 -2.02 0.00 0.00 58.31 55.27 2d9h n LYS 46 Cb 0.00 -1.57 -0.12 0.00 -0.02 0.00 0.00 35.03 33.32 2d9h n LYS 46 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2d9h s ARG 47 N -3.88 0.24 0.16 1.97 0.52 -1.26 0.18 118.95 116.88 2d9h s ARG 47 Ca 0.42 0.32 0.07 0.00 -0.52 0.00 0.00 55.73 56.02 2d9h s ARG 47 Cb -0.07 0.09 -0.04 0.00 0.52 0.00 0.00 34.95 35.44 2d9h s ARG 47 CO 0.35 -0.05 -0.16 -0.06 0.02 0.00 0.00 175.30 175.41 2d9h s PHE 48 N 0.26 1.65 -0.69 -0.53 0.40 -0.35 -4.83 117.98 113.89 2d9h s PHE 48 Ca -0.01 -0.53 0.19 0.00 -0.60 0.00 0.00 56.93 55.98 2d9h s PHE 48 Cb -0.03 -0.82 0.81 0.00 0.51 0.00 0.00 43.02 43.49 2d9h s PHE 48 CO -0.01 0.27 1.58 -0.85 0.70 0.00 0.00 175.22 176.91 2d9h n GLU 49 N 0.21 0.11 -3.52 0.44 0.28 -1.26 -0.86 120.64 116.04 2d9h n GLU 49 Ca -0.13 0.37 -0.11 0.00 -0.16 0.00 0.00 57.16 57.13 2d9h n GLU 49 Cb 0.58 -1.71 -0.03 0.00 1.43 0.00 0.00 31.44 31.70 2d9h n GLU 49 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 177.13 175.38 2d9h s LYS 50 N -3.19 1.18 0.12 3.44 -2.85 -1.26 -4.59 119.74 112.59 2d9h s LYS 50 Ca 0.05 -0.58 -0.13 0.00 -1.00 0.00 0.00 55.97 54.31 2d9h s LYS 50 Cb 0.09 0.54 -0.06 0.00 -2.06 0.00 0.00 37.83 36.33 2d9h s LYS 50 CO 0.31 -0.50 1.45 -1.00 0.10 0.00 0.00 175.35 175.72 2d9h h PRO 51 N 2.17 0.83 -1.09 1.78 0.13 -1.91 -3.08 132.00 130.82 2d9h h PRO 51 Ca -0.34 -0.44 0.32 0.00 -0.87 0.00 0.00 66.00 64.67 2d9h h PRO 51 Cb 1.29 0.02 -0.12 0.00 0.13 0.00 0.00 31.00 32.31 2d9h h PRO 51 CO 0.42 1.08 0.67 0.22 -0.23 0.00 0.00 178.00 180.16 2d9h h ASP 52 N 0.62 0.44 0.91 1.44 3.58 -1.99 0.78 116.42 122.20 2d9h h ASP 52 Ca 0.05 0.14 -0.22 0.00 0.42 0.00 0.00 57.03 57.42 2d9h h ASP 52 Cb 0.92 0.08 -0.02 0.00 1.72 0.00 0.00 39.33 42.03 2d9h h ASP 52 CO 0.08 -0.05 -1.02 -1.28 -2.88 0.00 0.00 179.24 174.09 2d9h h SER 53 N 0.32 0.08 0.42 2.28 0.87 -1.98 -3.12 113.55 112.42 2d9h h SER 53 Ca 0.70 -0.08 -0.10 0.00 -1.23 0.00 0.00 61.79 61.08 2d9h h SER 53 Cb 1.79 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 63.71 2d9h h SER 53 CO -0.44 1.05 -0.46 0.58 -0.53 0.00 0.00 176.83 177.03 2d9h h VAL 54 N 0.02 1.33 -0.03 2.23 2.07 0.54 -0.83 116.25 121.57 2d9h h VAL 54 Ca -0.03 -1.58 -0.23 0.00 0.82 0.00 0.00 66.70 65.67 2d9h h VAL 54 Cb 1.77 1.83 0.01 0.00 -1.52 0.00 0.00 31.29 33.38 2d9h h VAL 54 CO 0.14 0.46 -0.92 0.00 0.02 0.00 0.00 177.57 177.26 2d9h h ALA 55 N 1.50 0.32 -0.08 1.67 0.00 -0.95 -3.18 119.26 118.54 2d9h h ALA 55 Ca -0.00 -0.68 -0.24 0.00 0.00 0.00 0.00 54.91 54.00 2d9h h ALA 55 Cb 0.82 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.63 2d9h h ALA 55 CO 0.06 0.75 -0.89 0.00 0.00 0.00 0.00 179.25 179.18 2d9h h ALA 56 N 0.64 0.28 -0.63 0.00 0.00 -1.46 -3.18 119.26 114.90 2d9h h ALA 56 Ca -0.08 -0.65 0.10 0.00 0.00 0.00 0.00 54.91 54.28 2d9h h ALA 56 Cb 1.56 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.31 2d9h h ALA 56 CO 0.17 0.70 0.42 1.25 0.00 0.00 0.00 179.25 181.79 2d9h h HIS 57 N 0.44 0.48 0.00 0.00 -0.00 -1.22 0.22 115.15 115.08 2d9h h HIS 57 Ca -0.08 0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.30 2d9h h HIS 57 Cb 1.52 -0.16 -0.00 0.00 -0.00 0.00 0.00 27.41 28.77 2d9h h HIS 57 CO 0.09 0.23 -0.02 0.00 -0.00 0.00 0.00 177.93 178.22 2d9h h ARG 58 N 0.46 0.00 -0.01 5.26 3.08 -1.53 0.70 114.38 122.34 2d9h h ARG 58 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.34 2d9h h ARG 58 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.58 2d9h h ARG 58 CO -0.08 0.02 -0.45 0.45 -1.07 0.00 0.00 179.97 178.84 2d9h n SER 59 N -3.12 0.99 -0.01 7.04 2.88 0.70 -0.52 113.62 121.58 2d9h n SER 59 Ca 0.01 -0.78 -0.00 0.00 -1.33 0.00 0.00 58.87 56.77 2d9h n SER 59 Cb 0.37 0.32 -0.02 0.00 -0.75 0.00 0.00 64.21 64.13 2d9h n SER 59 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2d9h n LYS 60 N -0.93 2.56 -0.04 -1.46 5.02 -0.82 -4.33 118.16 118.17 2d9h n LYS 60 Ca 0.09 -0.01 -0.04 0.00 -2.02 0.00 0.00 58.31 56.33 2d9h n LYS 60 Cb 0.36 -1.05 -0.06 0.00 -0.02 0.00 0.00 35.03 34.26 2d9h n LYS 60 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2d9h n SER 61 N -1.92 3.25 -0.86 4.39 7.64 0.24 -4.65 113.62 121.71 2d9h n SER 61 Ca -0.02 -0.00 0.01 0.00 1.01 0.00 0.00 58.87 59.86 2d9h n SER 61 Cb 0.41 0.64 0.19 0.00 -1.01 0.00 0.00 64.21 64.45 2d9h n SER 61 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2d9h n HIS 62 N -2.28 0.49 0.44 1.43 8.25 -0.57 -4.71 115.22 118.27 2d9h n HIS 62 Ca -0.12 -1.59 0.09 0.00 -0.26 0.00 0.00 57.72 55.84 2d9h n HIS 62 Cb 0.73 -0.33 0.40 0.00 1.12 0.00 0.00 29.99 31.91 2d9h n HIS 62 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2d9h n PRO 63 N -1.09 0.10 0.01 -0.41 -0.04 0.32 -2.01 135.00 131.87 2d9h n PRO 63 Ca 0.25 0.34 0.12 0.00 -0.04 0.00 0.00 63.50 64.17 2d9h n PRO 63 Cb 0.80 -1.69 0.15 0.00 -0.04 0.00 0.00 33.50 32.72 2d9h n PRO 63 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2d9h n ALA 64 N -1.64 3.71 -0.12 0.55 0.00 -1.26 -4.16 120.51 117.58 2d9h n ALA 64 Ca 0.03 -0.39 -0.24 0.00 0.00 0.00 0.00 53.44 52.83 2d9h n ALA 64 Cb 0.20 -1.04 -0.11 0.00 0.00 0.00 0.00 19.45 18.50 2d9h n ALA 64 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2d9h n LEU 65 N -1.59 1.90 -0.27 0.00 4.77 -0.85 -4.42 117.00 116.53 2d9h n LEU 65 Ca 0.05 0.39 0.02 0.00 -0.03 0.00 0.00 56.01 56.44 2d9h n LEU 65 Cb 0.35 -0.91 0.09 0.00 -2.33 0.00 0.00 43.42 40.62 2d9h n LEU 65 CO 0.37 0.37 0.70 -0.07 -1.33 0.00 0.00 177.39 177.43 2d9h h LEU 66 N -1.00 -0.75-10.01 2.23 3.38 -1.71 -3.41 115.31 104.04 2d9h h LEU 66 Ca -0.47 0.23 -0.56 0.00 0.09 0.00 0.00 57.88 57.17 2d9h h LEU 66 Cb 1.41 0.49 0.17 0.00 0.09 0.00 0.00 40.66 42.81 2d9h h LEU 66 CO -0.29 -0.26 0.32 -0.11 0.09 0.00 0.00 178.44 178.19 2d9h n LEU 67 N -5.50 4.86 -4.64 1.67 7.94 -1.26 -4.95 117.00 115.12 2d9h n LEU 67 Ca 0.10 0.77 -0.32 0.00 -1.11 0.00 0.00 56.01 55.46 2d9h n LEU 67 Cb 0.39 -1.48 0.16 0.00 0.53 0.00 0.00 43.42 43.02 2d9h n LEU 67 CO -0.02 -1.48 0.59 0.00 -1.11 0.00 0.00 177.39 175.38 2d9h n ALA 68 N -2.08 -0.96 -2.06 1.96 0.00 -1.26 -4.83 120.51 111.28 2d9h n ALA 68 Ca 0.15 -0.54 -0.28 0.00 0.00 0.00 0.00 53.44 52.77 2d9h n ALA 68 Cb 0.48 -2.15 -0.06 0.00 0.00 0.00 0.00 19.45 17.72 2d9h n ALA 68 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2d9h s PRO 69 N -4.45 2.52 -0.23 0.00 0.04 -1.26 -4.66 135.00 126.96 2d9h s PRO 69 Ca 0.66 -0.80 -0.16 0.00 0.04 0.00 0.00 61.00 60.75 2d9h s PRO 69 Cb -0.23 -5.17 -0.11 0.00 0.04 0.00 0.00 34.50 29.03 2d9h s PRO 69 CO 0.58 -3.72 -0.23 1.04 0.04 0.00 0.00 177.00 174.71 2d9h n GLN 70 N 8.53 0.56 -0.18 4.56 6.02 -1.26 -4.63 117.38 130.97 2d9h n GLN 70 Ca 0.43 0.34 0.08 0.00 -0.01 0.00 0.00 57.00 57.83 2d9h n GLN 70 Cb 0.47 -1.55 0.15 0.00 1.02 0.00 0.00 30.24 30.34 2d9h n GLN 70 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 2d9h n GLU 71 N -4.37 2.18 -0.05 -1.09 -0.58 -1.26 -4.73 120.64 110.73 2d9h n GLU 71 Ca -0.37 -2.44 -0.08 0.00 -0.42 0.00 0.00 57.16 53.85 2d9h n GLU 71 Cb 0.71 -1.50 -0.02 0.00 -0.57 0.00 0.00 31.44 30.06 2d9h n GLU 71 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2d9h h SER 72 N 0.72 -0.20 -0.89 1.62 0.87 -1.90 -2.54 113.55 111.22 2d9h h SER 72 Ca 0.00 0.07 0.16 0.00 -1.23 0.00 0.00 61.79 60.79 2d9h h SER 72 Cb 1.03 0.14 -0.16 0.00 -0.44 0.00 0.00 62.40 62.97 2d9h h SER 72 CO 0.07 -0.07 -0.28 -1.54 -0.53 0.00 0.00 176.83 174.47 2d9h n SER 73 N -5.21 -0.44 -3.32 6.23 3.41 -1.26 -4.46 113.62 108.57 2d9h n SER 73 Ca -0.02 1.55 -0.24 0.00 -0.26 0.00 0.00 58.87 59.90 2d9h n SER 73 Cb 0.14 -0.42 0.21 0.00 -0.26 0.00 0.00 64.21 63.88 2d9h n SER 73 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d9h n GLY 74 N -1.50 -2.90 3.72 5.00 0.00 -0.96 -4.96 105.19 103.60 2d9h n GLY 74 Ca 0.12 -1.45 -0.42 0.00 0.00 0.00 0.00 46.02 44.27 2d9h n GLY 74 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d9h s PRO 75 N -4.95 4.35 0.17 1.61 0.04 -1.26 -5.03 135.00 129.93 2d9h s PRO 75 Ca 0.57 2.04 0.08 0.00 0.04 0.00 0.00 61.00 63.72 2d9h s PRO 75 Cb -0.06 -3.24 -0.04 0.00 0.04 0.00 0.00 34.50 31.20 2d9h s PRO 75 CO 0.44 -0.36 -0.02 -1.54 0.04 0.00 0.00 177.00 175.56 2d9h s SER 76 N 0.84 4.66 0.21 6.66 1.04 -1.26 -5.03 113.70 120.81 2d9h s SER 76 Ca 0.61 -0.43 -0.11 0.00 0.48 0.00 0.00 55.95 56.51 2d9h s SER 76 Cb -0.36 -0.95 0.28 0.00 0.10 0.00 0.00 66.02 65.08 2d9h s SER 76 CO 0.33 0.10 1.70 -1.28 0.98 0.00 0.00 173.24 175.06 2d9h h SER 77 N 2.79 -0.05 0.00 7.02 0.87 -2.01 -3.55 113.55 118.62 2d9h h SER 77 Ca -0.47 0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.21 2d9h h SER 77 Cb 1.20 0.17 0.00 0.00 -0.44 0.00 0.00 62.40 63.33 2d9h h SER 77 CO 0.57 -0.01 0.00 0.61 -0.53 0.00 0.00 176.83 177.47